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First principles study of Seebeck coefficients of doped semiconductors ZnTe1−xFx and ZnTe1−yNy
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10.1063/1.3679569
/content/aip/journal/jap/111/3/10.1063/1.3679569
http://aip.metastore.ingenta.com/content/aip/journal/jap/111/3/10.1063/1.3679569
View: Figures

Figures

Image of FIG. 1.
FIG. 1.

(Color online) Densities of states for ZnTe1-xFx. The percentage ofdoped atom F is (a) x = 1/16, (b) x = 1/32, (c) x = 1/64, and (d) x = 1/128. The energy references are set at the Fermi levels.

Image of FIG. 2.
FIG. 2.

(Color online) Densities of states for ZnTe1−yNy. The percentage of doped atom N is (a) y = 1/16, (b) y = 1/32, and (c) y = 1/64. The energy references are set at the Fermi levels.

Image of FIG. 3.
FIG. 3.

(Color online) The temperature dependence of (a) Seebeck coefficient, (b) electrical conductivity, and (c) power factor for ZnTe1−xFx, which are calculated by using the DOS from first principles calculations. The four curves with symbols “○,” “Δ,” “◊,” and “⋆” correspond to percentages x = 1/16, 1/32, 1/64, and 1/128, respectively.

Image of FIG. 4.
FIG. 4.

(Color online) The temperature dependence of (a) Seebeck coefficient, (b) electrical conductivity, and (c) power factor for ZnTe1−yNy, which are calculated by using the DOS from first principles calculations. The three curves with symbols “○,” “Δ,” and “◊” correspond to percentages y = 1/16, 1/32, and 1/64, respectively.

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/content/aip/journal/jap/111/3/10.1063/1.3679569
2012-02-02
2014-04-19
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752b84549af89a08dbdd7fdb8b9568b5 journal.articlezxybnytfddd
Scitation: First principles study of Seebeck coefficients of doped semiconductors ZnTe1−xFx and ZnTe1−yNy
http://aip.metastore.ingenta.com/content/aip/journal/jap/111/3/10.1063/1.3679569
10.1063/1.3679569
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